4-[6-(3-fluorophenyl)pyrimidin-4-yl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide
Chemical Structure Depiction of
4-[6-(3-fluorophenyl)pyrimidin-4-yl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide
4-[6-(3-fluorophenyl)pyrimidin-4-yl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | L262-0780 |
| Compound Name: | 4-[6-(3-fluorophenyl)pyrimidin-4-yl]-N-[3-(methylsulfanyl)phenyl]piperazine-1-carboxamide |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C22 H22 F N5 O S |
| Smiles: | CSc1cccc(c1)NC(N1CCN(CC1)c1cc(c2cccc(c2)F)ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8249 |
| logD: | 4.8231 |
| logSw: | -4.6078 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.97 |
| InChI Key: | RMQUMIWQAUWGNU-UHFFFAOYSA-N |